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1-(4-Bromo-2-fluorophenyl)ethanone

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1-(4-Bromo-2-fluorophenyl)ethanone Basic information

Product Name:
1-(4-Bromo-2-fluorophenyl)ethanone
Synonyms:
  • 1-Acetyl-4-bromo-2-fluorobenzene
  • 1-(4-Bromo-2-fluorophenyl)ethan-1-one
  • 1-(4-broMophenyl)-2-fluoroethan-1-one
  • Ethanone, 1-(4-broMo-2-fluorophenyl)-
  • 4-Bromo-2-fluoroacetophenone/2-Fluoro-4-bromoacetophenone
  • 4'-Bromo-2'-fluoroacetophenone 98%
  • 4'-Bromo-2'-fluoroacetophenone98%
  • 4-BROMO-2-FLUOROACETOPHENONE
CAS:
625446-22-2
MF:
C8H6BrFO
MW:
217.04
EINECS:
205-516-1
Product Categories:
  • Fluorine series
  • Adehydes, Acetals & Ketones
  • Bromine Compounds
  • Fluorine Compounds
Mol File:
625446-22-2.mol
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1-(4-Bromo-2-fluorophenyl)ethanone Chemical Properties

Melting point:
23 °C
Boiling point:
256.3±25.0 °C(Predicted)
Density 
1.535±0.06 g/cm3(Predicted)
storage temp. 
Sealed in dry,Room Temperature
solubility 
Acetonitrile (Slightly), Chloroform (Slightly)
form 
Solid
color 
White to Off-White
InChI
InChI=1S/C8H6BrFO/c1-5(11)7-3-2-6(9)4-8(7)10/h2-4H,1H3
InChIKey
ASKFCSCYGAFWAB-UHFFFAOYSA-N
SMILES
C(=O)(C1=CC=C(Br)C=C1F)C
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Safety Information

Hazard Codes 
Xi
Risk Statements 
36/37/38-36
Safety Statements 
26-36/37/39
Hazard Note 
Irritant
HS Code 
2914790090
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1-(4-Bromo-2-fluorophenyl)ethanone Usage And Synthesis

Synthesis

To a solution of 4-bromo-2-fluoro-N-methoxy-N-methylbenzamide (13 g, 46 mmol) in THF (4.0 mL) was added dropwise methylmagnesium bromide (3M ethyl ether solution, 30 mL, 91 mmol) at 0°C, and the mixture was stirred at room temperature for 3 hr. For the reaction mixture, saturated aqueous ammonium chloride solution, and the mixture was extracted with ethyl acetate. The obtained extract was washed with water and saturated brine, and dried over anhydrous magnesium sulfate. The solvent was evaporated under reduced pressure to give 4-Bromo-2-fluoroacetophenone as a pale yellow oil.

References

[1] Patent: US2008/45556, 2008, A1. Location in patent: Page/Page column 32
[2] Patent: US2011/118257, 2011, A1. Location in patent: Page/Page column 97-98
[3] Patent: US2011/281865, 2011, A1. Location in patent: Page/Page column 85-86
[4] Patent: WO2011/145035, 2011, A1. Location in patent: Page/Page column 114-115
[5] Journal of Medicinal Chemistry, 2008, vol. 51, # 2, p. 282 - 297

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